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Materials Project

The Materials Project at Berkeley National Labs

Source Website Cite API JSON Python-client

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Filter mix-ins: ['Structure', 'Thermodynamics']

Extra filters: ['energy_uncorrected__range', 'band_gap__range', 'is_gap_direct', 'is_magnetic', 'total_magnetization__range', 'is_theoretical']

Nelements is in range

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Formula anonymous

Formula full

Formula reduced

Chemical system

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Nsites is in range

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Density is in range

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Density atomic is in range

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Volume is in range

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Volume molar is in range

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Spacegroup number

Spacegroup symbol

Spacegroup crystal system

Spacegroup point group

Energy is in range

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Energy per atom is in range

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Energy above hull is in range

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Is stable

Formation energy is in range

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Formation energy is in range

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This table includes 146323 results that match your search criteria. These results were filtered from the 146323 total possible results.

ID	Dashboards	Full Formula	Spacegroup	Density
mp-1061823	simmate / provider	Ca₁ C₂	12	0.040
mp-570752	simmate / provider	H₂	194	0.039
mp-1068462	simmate / provider	La₂ S₂	25	0.038
mp-730101	simmate / provider	H₈	19	0.036
mp-632250	simmate / provider	H₁	229	0.024
mp-1101023	simmate / provider	Ti₂ S₂	59	0.021
mp-1101037	simmate / provider	Ti₂ N₂ F₂	9	0.020

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Workflow Type

Materials Project

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